In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 29 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.13 | 7.81 | -23.93 | 1 | 6 | 0 | 75 | 428.583 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 10.09 | -47.16 | 2 | 6 | 1 | 76 | 429.591 | 6 | ↓ |